3-(fluoromethyl)-3-methoxyazetidine

C5H10FNO — CID 139022685

IUPAC3-(fluoromethyl)-3-methoxyazetidine
SMILESCOC1(CF)CNC1
InChIInChI=1S/C5H10FNO/c1-8-5(2-6)3-7-4-5/h7H,2-4H2,1H3
InChIKeyKYQORJNYGMDLEB-UHFFFAOYSA-N
MW119.14 g/mol
LogP-0.06
Rot. Bonds2

About 3-(fluoromethyl)-3-methoxyazetidine

3-(fluoromethyl)-3-methoxyazetidine (PubChem CID 139022685) has the molecular formula C5H10FNO and a molecular weight of 119.14 g/mol. Its IUPAC name is 3-(fluoromethyl)-3-methoxyazetidine.

Molecular Properties

Compound Name3-(fluoromethyl)-3-methoxyazetidine
PubChem CID139022685
Molecular FormulaC5H10FNO
Molecular Weight119.14 g/mol
Exact Mass119.07
IUPAC Name3-(fluoromethyl)-3-methoxyazetidine
SMILESCOC1(CF)CNC1
InChIInChI=1S/C5H10FNO/c1-8-5(2-6)3-7-4-5/h7H,2-4H2,1H3
InChIKeyKYQORJNYGMDLEB-UHFFFAOYSA-N
XLogP-0.06
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.14
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(fluoromethyl)-3-methoxyazetidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Methoxy-3-methylazetidine hydrochloride
CID 53346546
3-Ethoxy-3-methylazetidine
CID 83066072
3-Ethoxy-3-methylazetidine hydrochloride
CID 124124155
3-Methoxy-3-(trifluoromethyl)azetidine hydrochloride
CID 132327547
3-(Difluoromethyl)-3-methoxyazetidine hydrochloride
CID 145913729
3-Methyl-3-(trifluoromethoxy)azetidine hydrochloride
CID 155714428
3-(Difluoromethoxy)-3-methylazetidine
CID 114782806
3-(Fluoromethyl)-3-methoxyazetidine hydrochloride
CID 139022684
3-Methoxy-3-methylazetidine
CID 46911956
(2-Methoxy-2-methylpropyl)(methyl)amine
CID 58989744
3-Methoxy-3-(trifluoromethyl)azetidine
CID 121203413
3-Ethoxy-3-(trifluoromethyl)azetidine
CID 121203436

Frequently Asked Questions

What is the IUPAC name of 3-(fluoromethyl)-3-methoxyazetidine?
The IUPAC name of 3-(fluoromethyl)-3-methoxyazetidine (CID 139022685) is 3-(fluoromethyl)-3-methoxyazetidine.
What is the SMILES notation for 3-(fluoromethyl)-3-methoxyazetidine?
The canonical SMILES for 3-(fluoromethyl)-3-methoxyazetidine is COC1(CF)CNC1.
What is the InChIKey of 3-(fluoromethyl)-3-methoxyazetidine?
The InChIKey is KYQORJNYGMDLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO/c1-8-5(2-6)3-7-4-5/h7H,2-4H2,1H3.
What are the key properties of 3-(fluoromethyl)-3-methoxyazetidine?
3-(fluoromethyl)-3-methoxyazetidine has a molecular weight of 119.14 g/mol, XLogP of -0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(fluoromethyl)-3-methoxyazetidine is sourced from PubChem (CID 139022685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).